============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 14 rings ring int. center anis. iso. TRP 13 1.040 -22.483 14.689 -5.650 -99.200 -91.000 TRP6 13 1.020 -22.814 15.840 -7.709 -99.200 -91.000 TRP 17 1.040 -18.604 2.873 -18.337 -99.200 -91.000 TRP6 17 1.020 -16.559 2.011 -19.214 -99.200 -91.000 HIS 29 0.900 -11.028 13.310 -0.133 -99.200 -91.000 TYR 38 0.840 -7.603 4.996 -8.881 -99.200 -91.000 TYR 44 0.840 -11.408 5.489 -5.775 -99.200 -91.000 TRP 47 1.040 -6.367 0.178 -7.063 -99.200 -91.000 TRP6 47 1.020 -6.343 1.757 -5.312 -99.200 -91.000 PHE 49 1.000 -16.286 -2.621 -3.086 -99.200 -91.000 TYR 51 0.840 -15.046 -7.825 -3.467 -99.200 -91.000 PHE 66 1.000 -16.641 7.125 -3.145 -99.200 -91.000 HIS 74 0.900 -19.996 -4.498 -21.175 -99.200 -91.000 HIS 82 0.900 -24.242 8.421 2.458 -99.200 -91.000